Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.46 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 8/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.41 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL538344 | 0.85 | DGAT1 (0.55) | DGAT1PDPK1AKR1B1P2RX7MEN1 | |
| SCHEMBL29574602 | 0.85 | DGAT1 (0.46) | DGAT1PDPK1AKR1B1P2RX7MEN1 | |
| SCHEMBL31551664 | 0.85 | DGAT1 (0.55) | DGAT1PDPK1AKR1B1P2RX7MEN1 | |
| SCHEMBL8696600 | 0.85 | DGAT1 (0.46) | DGAT1PDPK1AKR1B1P2RX7MEN1 | |
| SCHEMBL29574729 | 0.83 | AKR1B1 (0.52) | DGAT1PDPK1AKR1B1P2RX7MEN1 | |
| SCHEMBL5835 | 0.83 | AKR1B1 (0.52) | DGAT1PDPK1AKR1B1P2RX7MEN1 | |
| SCHEMBL8444 | 0.81 | DGAT1 (0.46) | DGAT1PDPK1AKR1B1P2RX7MEN1 | |
| SCHEMBL16257133 | 0.81 | IDO1 (0.46) | P2RX7 | |
| SCHEMBL12501525 | 0.79 | DGAT1 (0.43) | DGAT1PDPK1AKR1B1P2RX7MEN1 | |
| SCHEMBL22235337 | 0.79 | DGAT1 (0.43) | DGAT1PDPK1AKR1B1P2RX7MEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014141187-A1 | PYRIDINE DERIVATIVES AS REARRANGED DURING TRANSFECTION (RET) KINASE INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2014-09-18 | — | — | WO | disclosed |